data_1y0n_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1y0n _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' -1' ' ' GLY . . . . . 0.523 ' CA ' ' CB ' ' A' ' 0' ' ' HIS . . . . . . . . 0 N--CA 1.507 3.402 0 N-CA-C 115.683 1.033 . . . . 63.49 115.683 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 0' ' ' HIS . . . . . 0.523 ' CB ' ' CA ' ' A' ' -1' ' ' GLY . 79.1 m-70 81.9 109.97 0.07 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 115.313 1.597 . . . . 59.98 115.313 -13.036 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' MET . . . . . 0.448 ' CB ' ' O ' ' A' ' 119' ' ' HOH . 0.1 OUTLIER -118.58 157.46 27.3 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 115.297 -0.865 . . . . 59.5 110.093 173.415 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 81.8 mt -79.76 137.5 37.02 Favored 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 112.327 0.492 . . . . 49.25 112.327 172.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ILE . . . . . 1.04 ' O ' ' O2 ' ' A' ' 101' ' ' GOL . 14.9 pt -128.56 127.35 23.59 Favored Pre-proline 0 C--O 1.255 1.391 0 C-N-CA 122.992 0.517 . . . . 50.75 111.63 172.233 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -61.37 137.99 73.72 Favored 'Trans proline' 0 CA--C 1.535 0.575 0 C-N-CA 117.867 -0.956 . . . . 43.63 110.879 -176.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 54.6 p-80 -55.23 -34.69 64.2 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.104 1.15 . . . . 45.58 114.104 -178.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -73.97 -8.15 55.02 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 124.025 0.828 . . . . 59.99 112.893 -177.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 25.6 tp -87.03 -12.78 46.34 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 109.076 -0.713 . . . . 50.17 109.076 174.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 31.4 mt -84.01 143.88 29.49 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 115.458 1.651 . . . . 45.81 115.458 -171.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -57.42 130.45 46.33 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 112.43 -2.168 . . . . 53.6 106.923 171.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.73 -38.49 75.41 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.718 1.747 . . . . 48.71 115.718 -168.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -72.36 -39.65 67.94 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 113.761 1.022 . . . . 60.74 113.761 179.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . 0.278 0.7 OUTLIER -64.41 -39.75 94.44 Favored 'General case' 0 C--O 1.187 -2.232 0 C-N-CA 116.815 -1.954 . . . . 51.94 107.727 176.11 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 23.7 tp -58.68 -39.92 82.06 Favored 'General case' 0 N--CA 1.487 1.403 0 CA-C-N 119.545 1.066 . . . . 38.99 112.617 177.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ASN . . . . . 0.467 ' OD1' ' NH2' ' A' ' 42' ' ' ARG . 86.0 m-20 -64.85 -43.04 94.32 Favored 'General case' 0 CA--C 1.476 -1.891 0 N-CA-C 111.946 0.35 . . . . 51.5 111.946 -178.336 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -62.44 -45.59 92.39 Favored 'General case' 0 CA--C 1.548 0.9 0 O-C-N 125.313 1.633 . . . . 48.79 110.796 175.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 52.0 mt -59.17 -41.86 89.43 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 122.13 -0.356 . . . . 34.76 111.368 174.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 31.4 mt -64.23 -46.34 84.24 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 120.541 0.21 . . . . 33.89 111.36 179.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -60.83 -46.11 91.83 Favored 'General case' 0 C--O 1.25 1.085 0 C-N-CA 123.146 0.579 . . . . 52.37 111.984 176.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -53.61 -47.65 70.0 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-O 121.252 0.549 . . . . 45.36 110.804 174.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -63.11 -49.48 74.28 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-N 116.31 -0.405 . . . . 38.46 110.022 -172.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 12.9 m -75.81 -8.84 12.18 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 113.133 0.79 . . . . 40.94 113.133 -174.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.1 p -109.73 6.87 24.0 Favored 'General case' 0 N--CA 1.44 -0.973 0 C-N-CA 118.719 -1.192 . . . . 47.49 112.833 170.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.5 ptt180 . . . . . 0 N--CA 1.488 1.459 0 N-CA-C 115.178 1.547 . . . . 64.73 115.178 -176.77 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 . . . . . 0 CA--C 1.561 1.394 0 CA-C-O 121.502 0.667 . . . . 66.55 111.217 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 63.2 m -59.64 132.27 88.7 Favored Pre-proline 0 C--O 1.211 -0.924 0 O-C-N 121.244 -0.91 . . . . 49.87 110.647 177.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_exo -58.85 152.6 56.32 Favored 'Trans proline' 0 C--O 1.256 1.377 0 CA-C-N 118.805 0.609 . . . . 43.52 113.107 177.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.0 tp -48.74 -51.41 29.06 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 114.137 1.162 . . . . 45.81 114.137 178.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.42 -39.14 86.32 Favored 'General case' 0 N--CA 1.425 -1.686 0 O-C-N 124.446 1.091 . . . . 55.91 113.766 -176.546 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 27.7 t -61.76 -46.67 96.03 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.674 0 CA-C-O 122.251 1.024 . . . . 37.87 111.291 173.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.8 mtm180 -61.69 -39.53 91.78 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.314 -0.857 . . . . 59.42 111.021 178.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 44.9 t -63.89 -43.3 97.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 N-CA-C 109.237 -0.653 . . . . 31.26 109.237 177.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -65.22 -37.32 86.89 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 119.369 -0.932 . . . . 52.04 111.546 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -61.72 -40.19 94.18 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 108.867 -0.79 . . . . 41.55 108.867 175.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.57 -35.82 77.91 Favored 'General case' 0 CA--C 1.566 1.571 0 CA-C-O 121.937 0.875 . . . . 29.82 112.945 178.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ARG . . . . . 0.467 ' NH2' ' OD1' ' A' ' 14' ' ' ASN . 84.5 mtt-85 -64.2 -40.06 95.28 Favored 'General case' 0 N--CA 1.44 -0.947 0 O-C-N 121.138 -0.976 . . . . 46.81 110.818 177.119 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 72.5 t60 -62.59 -44.62 95.87 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 124.039 0.837 . . . . 38.75 109.756 175.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.93 -39.17 80.77 Favored 'General case' 0 C--O 1.248 0.992 0 N-CA-C 108.591 -0.892 . . . . 29.24 108.591 178.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 59.8 mt -66.44 -43.79 84.64 Favored 'General case' 0 C--O 1.296 3.507 0 CA-C-O 121.33 0.586 . . . . 31.12 111.507 176.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 81.4 mtm-85 -59.89 -36.22 76.49 Favored 'General case' 0 C--O 1.246 0.917 0 N-CA-C 113.971 1.1 . . . . 42.28 113.971 173.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 69.6 mtp85 -82.83 -1.35 51.63 Favored 'General case' 0 N--CA 1.502 2.129 0 CA-C-O 121.763 0.792 . . . . 35.97 112.655 178.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 65.29 18.94 65.83 Favored Glycine 0 N--CA 1.469 0.892 0 N-CA-C 116.124 1.209 . . . . 31.31 116.124 -173.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -89.09 -14.45 36.25 Favored 'General case' 0 C--O 1.203 -1.35 0 N-CA-C 113.613 0.968 . . . . 40.49 113.613 178.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -121.04 147.9 44.88 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 105.001 -2.222 . . . . 29.94 105.001 162.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 32.6 m -135.5 170.62 18.8 Favored 'Isoleucine or valine' 0 C--O 1.269 2.117 0 N-CA-C 107.701 -1.222 . . . . 29.94 107.701 -179.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 44.2 mt -118.08 123.39 71.57 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.3 0 CA-C-N 115.09 -0.959 . . . . 35.74 109.745 176.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 23.3 mt -97.61 134.52 40.7 Favored 'General case' 0 N--CA 1.438 -1.026 0 O-C-N 124.809 1.318 . . . . 42.29 111.835 174.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' PHE . . . . . 0.443 ' N ' ' O ' ' A' ' 1' ' ' MET . 67.0 t80 -122.92 132.29 54.1 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.141 -0.936 . . . . 47.3 112.022 179.554 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -103.7 108.95 61.16 Favored Pre-proline 0 C--O 1.206 -1.196 0 O-C-N 124.566 1.166 . . . . 56.45 109.61 179.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -35.84 -54.46 0.79 Allowed 'Trans proline' 0 N--CA 1.483 0.892 1 C-N-CA 128.184 5.923 . . . . 60.47 114.114 173.635 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLU . . . . . 0.445 ' O ' ' CB ' ' A' ' 58' ' ' SER . 14.9 pt-20 -97.11 141.02 30.75 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 107.178 -1.416 . . . . 67.48 107.178 173.976 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' SER . . . . . 0.445 ' CB ' ' O ' ' A' ' 57' ' ' GLU . 9.6 p 86.18 -28.04 0.08 Allowed 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.642 -1.244 . . . . 61.94 107.642 -163.939 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 50.84 18.02 0.47 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.173 0.989 . . . . 60.76 113.567 -176.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -86.86 147.57 25.74 Favored 'General case' 0 CA--C 1.56 1.361 0 CA-C-O 121.625 0.726 . . . . 67.05 112.94 -174.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 9.2 m -112.42 152.58 28.5 Favored 'General case' 0 C--O 1.255 1.355 0 C-N-CA 124.987 1.315 . . . . 51.42 109.17 179.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -149.57 138.2 20.9 Favored 'General case' 0 CA--C 1.56 1.34 0 CA-C-N 114.896 -1.047 . . . . 47.19 113.058 166.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -81.15 133.54 35.48 Favored 'General case' 0 N--CA 1.439 -1.021 0 N-CA-C 107.59 -1.263 . . . . 42.38 107.59 173.568 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 49.1 mtp -140.18 149.2 42.66 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 124.408 1.067 . . . . 36.86 110.205 178.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.6 mt -66.37 130.86 44.63 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 108.122 -1.066 . . . . 39.09 108.122 167.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 57.5 ttm-85 -45.24 -39.9 6.9 Favored 'General case' 0 N--CA 1.5 2.028 0 C-N-CA 122.859 0.463 . . . . 34.67 110.743 174.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 57.9 p -63.5 -23.54 67.44 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.909 1.283 . . . . 36.14 114.051 -179.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 77.2 mt-10 -94.12 -3.26 51.4 Favored 'General case' 0 C--O 1.253 1.247 0 N-CA-C 115.952 1.834 . . . . 48.63 115.952 176.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 26.9 t -90.47 127.99 50.63 Favored Pre-proline 0 CA--C 1.556 1.18 0 CA-C-N 115.011 -0.995 . . . . 34.92 110.693 179.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_exo -54.94 145.04 64.86 Favored 'Trans proline' 0 C--N 1.373 1.834 0 C-N-CA 120.867 1.044 . . . . 36.39 113.388 171.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.43 -37.56 72.98 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 119.412 -0.915 . . . . 36.99 111.405 -175.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 21.0 tp10 -54.03 -33.99 58.79 Favored 'General case' 0 C--O 1.198 -1.625 0 O-C-N 123.779 0.675 . . . . 64.23 112.553 179.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 31.1 mt -90.27 -2.98 58.06 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 115.202 1.556 . . . . 49.01 115.202 179.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 46.3 mt -103.56 -12.31 17.17 Favored 'General case' 0 C--O 1.246 0.885 0 N-CA-C 112.448 0.536 . . . . 51.79 112.448 174.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -80.48 105.16 11.52 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 126.54 1.936 . . . . 75.53 110.378 165.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 8.9 t70 . . . . . 0 C--O 1.252 1.191 0 O-C-N 123.818 0.698 . . . . 68.28 110.073 -153.086 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GOL . . . . . 1.04 ' O2 ' ' O ' ' A' ' 3' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GOL . . . . . 0.827 ' O1 ' ' O3 ' ' A' ' 102' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GOL . . . . . 0.827 ' O3 ' ' O1 ' ' A' ' 104' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GOL . . . . . 0.827 ' O2 ' ' O ' ' A' ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . 0.448 ' O ' ' CB ' ' A' ' 1' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . 0.827 ' O ' ' O2 ' ' A' ' 103' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' -1' ' ' GLY . . . . . 0.75 ' CA ' ' HB2' ' A' ' 0' ' ' HIS . . . . . . . . 0 N--CA 1.507 3.402 0 N-CA-C 115.683 1.033 . . . . 63.490000000000002 115.683 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 0' ' ' HIS . . . . . 0.75 ' HB2' ' CA ' ' A' ' -1' ' ' GLY . 79.1 m-70 81.9 109.97 0.07 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 115.313 1.597 . . . . 59.979999999999997 115.313 -13.036 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . 0.598 ' HB3' ' O ' ' A' ' 119' ' ' HOH . 0.1 OUTLIER -118.58 157.46 27.3 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 115.297 -0.865 . . . . 59.5 110.093 173.415 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LEU . . . . . 0.927 HD23 HD23 ' A' ' 53' ' ' LEU . 81.8 mt -79.76 137.5 37.02 Favored 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 112.327 0.492 . . . . 49.25 112.327 172.007 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ILE . . . . . 1.027 ' O ' ' O2 ' ' A' ' 101' ' ' GOL . 14.9 pt -128.56 127.35 23.59 Favored Pre-proline 0 C--O 1.255 1.391 0 C-N-CA 122.992 0.517 . . . . 50.75 111.63 172.233 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -61.37 137.99 73.72 Favored 'Trans proline' 0 CA--C 1.535 0.575 0 C-N-CA 117.867 -0.956 . . . . 43.630000000000003 110.879 -176.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 54.6 p-80 -55.23 -34.69 64.2 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.104 1.15 . . . . 45.579999999999998 114.104 -178.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -73.97 -8.15 55.02 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 124.025 0.828 . . . . 59.990000000000002 112.893 -177.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 25.6 tp -87.03 -12.78 46.34 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 109.076 -0.713 . . . . 50.170000000000002 109.076 174.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 31.4 mt -84.01 143.88 29.49 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 115.458 1.651 . . . . 45.810000000000002 115.458 -171.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLU . . . . . 0.637 ' OE1' HG23 ' A' ' 12' ' ' THR . 5.5 tm-20 -57.42 130.45 46.33 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 112.43 -2.168 . . . . 53.600000000000001 106.923 171.787 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.73 -38.49 75.41 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.718 1.747 . . . . 48.710000000000001 115.718 -168.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -72.36 -39.65 67.94 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 113.761 1.022 . . . . 60.740000000000002 113.761 179.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' THR . . . . . 0.637 HG23 ' OE1' ' A' ' 9' ' ' GLU 0.278 0.7 OUTLIER -64.41 -39.75 94.44 Favored 'General case' 0 C--O 1.187 -2.232 0 C-N-CA 116.815 -1.954 . . . . 51.939999999999998 107.727 176.11 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 23.7 tp -58.68 -39.92 82.06 Favored 'General case' 0 N--CA 1.487 1.403 0 CA-C-N 119.545 1.066 . . . . 38.990000000000002 112.617 177.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -64.85 -43.04 94.32 Favored 'General case' 0 CA--C 1.476 -1.891 0 N-CA-C 111.946 0.35 . . . . 51.5 111.946 -178.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -62.44 -45.59 92.39 Favored 'General case' 0 CA--C 1.548 0.9 0 O-C-N 125.313 1.633 . . . . 48.789999999999999 110.796 175.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 52.0 mt -59.17 -41.86 89.43 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 122.13 -0.356 . . . . 34.759999999999998 111.368 174.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 31.4 mt -64.23 -46.34 84.24 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 120.541 0.21 . . . . 33.890000000000001 111.36 179.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -60.83 -46.11 91.83 Favored 'General case' 0 C--O 1.25 1.085 0 C-N-CA 123.146 0.579 . . . . 52.369999999999997 111.984 176.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -53.61 -47.65 70.0 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-O 121.252 0.549 . . . . 45.359999999999999 110.804 174.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -63.11 -49.48 74.28 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-N 116.31 -0.405 . . . . 38.460000000000001 110.022 -172.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 12.9 m -75.81 -8.84 12.18 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 113.133 0.79 . . . . 40.939999999999998 113.133 -174.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.1 p -109.73 6.87 24.0 Favored 'General case' 0 N--CA 1.44 -0.973 0 C-N-CA 118.719 -1.192 . . . . 47.490000000000002 112.833 170.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.5 ptt180 . . . . . 0 N--CA 1.488 1.459 0 N-CA-C 115.178 1.547 . . . . 64.730000000000004 115.178 -176.77 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 . . . . . 0 CA--C 1.561 1.394 0 CA-C-O 121.502 0.667 . . . . 66.549999999999997 111.217 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 63.2 m -59.64 132.27 88.7 Favored Pre-proline 0 C--O 1.211 -0.924 0 O-C-N 121.244 -0.91 . . . . 49.869999999999997 110.647 177.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_exo -58.85 152.6 56.32 Favored 'Trans proline' 0 C--O 1.256 1.377 0 CA-C-N 118.805 0.609 . . . . 43.520000000000003 113.107 177.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.0 tp -48.74 -51.41 29.06 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 114.137 1.162 . . . . 45.810000000000002 114.137 178.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.42 -39.14 86.32 Favored 'General case' 0 N--CA 1.425 -1.686 0 O-C-N 124.446 1.091 . . . . 55.909999999999997 113.766 -176.546 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 27.7 t -61.76 -46.67 96.03 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.674 0 CA-C-O 122.251 1.024 . . . . 37.869999999999997 111.291 173.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.8 mtm180 -61.69 -39.53 91.78 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.314 -0.857 . . . . 59.420000000000002 111.021 178.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 44.9 t -63.89 -43.3 97.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 N-CA-C 109.237 -0.653 . . . . 31.260000000000002 109.237 177.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -65.22 -37.32 86.89 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 119.369 -0.932 . . . . 52.039999999999999 111.546 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -61.72 -40.19 94.18 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 108.867 -0.79 . . . . 41.549999999999997 108.867 175.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.57 -35.82 77.91 Favored 'General case' 0 CA--C 1.566 1.571 0 CA-C-O 121.937 0.875 . . . . 29.82 112.945 178.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 84.5 mtt-85 -64.2 -40.06 95.28 Favored 'General case' 0 N--CA 1.44 -0.947 0 O-C-N 121.138 -0.976 . . . . 46.810000000000002 110.818 177.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' HIS . . . . . 0.645 ' CD2' ' H2 ' ' A' ' 103' ' ' GOL . 72.5 t60 -62.59 -44.62 95.87 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 124.039 0.837 . . . . 38.75 109.756 175.573 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.93 -39.17 80.77 Favored 'General case' 0 C--O 1.248 0.992 0 N-CA-C 108.591 -0.892 . . . . 29.239999999999998 108.591 178.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 59.8 mt -66.44 -43.79 84.64 Favored 'General case' 0 C--O 1.296 3.507 0 CA-C-O 121.33 0.586 . . . . 31.120000000000001 111.507 176.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 81.4 mtm-85 -59.89 -36.22 76.49 Favored 'General case' 0 C--O 1.246 0.917 0 N-CA-C 113.971 1.1 . . . . 42.280000000000001 113.971 173.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 69.6 mtp85 -82.83 -1.35 51.63 Favored 'General case' 0 N--CA 1.502 2.129 0 CA-C-O 121.763 0.792 . . . . 35.969999999999999 112.655 178.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 65.29 18.94 65.83 Favored Glycine 0 N--CA 1.469 0.892 0 N-CA-C 116.124 1.209 . . . . 31.309999999999999 116.124 -173.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -89.09 -14.45 36.25 Favored 'General case' 0 C--O 1.203 -1.35 0 N-CA-C 113.613 0.968 . . . . 40.490000000000002 113.613 178.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -121.04 147.9 44.88 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 105.001 -2.222 . . . . 29.940000000000001 105.001 162.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' VAL . . . . . 0.49 ' HB ' ' H12' ' A' ' 101' ' ' GOL . 32.6 m -135.5 170.62 18.8 Favored 'Isoleucine or valine' 0 C--O 1.269 2.117 0 N-CA-C 107.701 -1.222 . . . . 29.940000000000001 107.701 -179.912 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ILE . . . . . 0.907 ' H ' ' H2 ' ' A' ' 101' ' ' GOL . 44.2 mt -118.08 123.39 71.57 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.3 0 CA-C-N 115.09 -0.959 . . . . 35.740000000000002 109.745 176.993 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LEU . . . . . 0.927 HD23 HD23 ' A' ' 2' ' ' LEU . 23.3 mt -97.61 134.52 40.7 Favored 'General case' 0 N--CA 1.438 -1.026 0 O-C-N 124.809 1.318 . . . . 42.289999999999999 111.835 174.949 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' PHE . . . . . 0.464 ' O ' ' HA ' ' A' ' 0' ' ' HIS . 67.0 t80 -122.92 132.29 54.1 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.141 -0.936 . . . . 47.299999999999997 112.022 179.554 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -103.7 108.95 61.16 Favored Pre-proline 0 C--O 1.206 -1.196 0 O-C-N 124.566 1.166 . . . . 56.450000000000003 109.61 179.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -35.84 -54.46 0.79 Allowed 'Trans proline' 0 N--CA 1.483 0.892 1 C-N-CA 128.184 5.923 . . . . 60.469999999999999 114.114 173.635 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLU . . . . . 0.445 ' O ' ' CB ' ' A' ' 58' ' ' SER . 14.9 pt-20 -97.11 141.02 30.75 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 107.178 -1.416 . . . . 67.480000000000004 107.178 173.976 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' SER . . . . . 0.445 ' CB ' ' O ' ' A' ' 57' ' ' GLU . 9.6 p 86.18 -28.04 0.08 Allowed 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.642 -1.244 . . . . 61.939999999999998 107.642 -163.939 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 50.84 18.02 0.47 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.173 0.989 . . . . 60.759999999999998 113.567 -176.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -86.86 147.57 25.74 Favored 'General case' 0 CA--C 1.56 1.361 0 CA-C-O 121.625 0.726 . . . . 67.049999999999997 112.94 -174.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' CYS . . . . . 0.415 ' SG ' HD11 ' A' ' 3' ' ' ILE . 9.2 m -112.42 152.58 28.5 Favored 'General case' 0 C--O 1.255 1.355 0 C-N-CA 124.987 1.315 . . . . 51.420000000000002 109.17 179.377 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -149.57 138.2 20.9 Favored 'General case' 0 CA--C 1.56 1.34 0 CA-C-N 114.896 -1.047 . . . . 47.189999999999998 113.058 166.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -81.15 133.54 35.48 Favored 'General case' 0 N--CA 1.439 -1.021 0 N-CA-C 107.59 -1.263 . . . . 42.380000000000003 107.59 173.568 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 49.1 mtp -140.18 149.2 42.66 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 124.408 1.067 . . . . 36.859999999999999 110.205 178.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.6 mt -66.37 130.86 44.63 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 108.122 -1.066 . . . . 39.090000000000003 108.122 167.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 57.5 ttm-85 -45.24 -39.9 6.9 Favored 'General case' 0 N--CA 1.5 2.028 0 C-N-CA 122.859 0.463 . . . . 34.670000000000002 110.743 174.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 57.9 p -63.5 -23.54 67.44 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.909 1.283 . . . . 36.140000000000001 114.051 -179.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 77.2 mt-10 -94.12 -3.26 51.4 Favored 'General case' 0 C--O 1.253 1.247 0 N-CA-C 115.952 1.834 . . . . 48.630000000000003 115.952 176.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 26.9 t -90.47 127.99 50.63 Favored Pre-proline 0 CA--C 1.556 1.18 0 CA-C-N 115.011 -0.995 . . . . 34.920000000000002 110.693 179.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_exo -54.94 145.04 64.86 Favored 'Trans proline' 0 C--N 1.373 1.834 0 C-N-CA 120.867 1.044 . . . . 36.390000000000001 113.388 171.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.43 -37.56 72.98 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 119.412 -0.915 . . . . 36.990000000000002 111.405 -175.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 21.0 tp10 -54.03 -33.99 58.79 Favored 'General case' 0 C--O 1.198 -1.625 0 O-C-N 123.779 0.675 . . . . 64.230000000000004 112.553 179.374 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 31.1 mt -90.27 -2.98 58.06 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 115.202 1.556 . . . . 49.009999999999998 115.202 179.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 46.3 mt -103.56 -12.31 17.17 Favored 'General case' 0 C--O 1.246 0.885 0 N-CA-C 112.448 0.536 . . . . 51.789999999999999 112.448 174.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ARG . . . . . 0.504 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 1.3 mmp_? -80.48 105.16 11.52 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 126.54 1.936 . . . . 75.530000000000001 110.378 165.761 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ASP . . . . . 0.504 ' HB2' ' O ' ' A' ' 75' ' ' ARG . 8.9 t70 . . . . . 0 C--O 1.252 1.191 0 O-C-N 123.818 0.698 . . . . 68.280000000000001 110.073 -153.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GOL . . . . . 1.027 ' O2 ' ' O ' ' A' ' 3' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GOL . . . . . 0.782 ' HO1' ' HO3' ' A' ' 102' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GOL . . . . . 0.782 ' HO3' ' HO1' ' A' ' 104' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GOL . . . . . 0.696 ' O2 ' ' O ' ' A' ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . 0.598 ' O ' ' HB3' ' A' ' 1' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . 0.696 ' O ' ' O2 ' ' A' ' 103' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' -1' ' ' GLY . . . . . 0.75 ' CA ' ' HB2' ' A' ' 0' ' ' HIS . . . . . . . . 0 N--CA 1.507 3.402 0 N-CA-C 115.683 1.033 . . . . 63.490000000000002 115.683 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' HIS . . . . . 0.75 ' HB2' ' CA ' ' A' ' -1' ' ' GLY . 79.1 m-70 81.9 109.97 0.07 Allowed 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 115.313 1.597 . . . . 59.979999999999997 115.313 -13.036 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . 0.598 ' HB3' ' O ' ' A' ' 119' ' ' HOH . 0.1 OUTLIER -118.58 157.46 27.3 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 115.297 -0.865 . . . . 59.5 110.093 173.415 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.927 HD23 HD23 ' A' ' 53' ' ' LEU . 81.8 mt -79.76 137.5 37.02 Favored 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 112.327 0.492 . . . . 49.25 112.327 172.007 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ILE . . . . . 1.027 ' O ' ' O2 ' ' A' ' 101' ' ' GOL . 14.9 pt -128.56 127.35 23.59 Favored Pre-proline 0 C--O 1.255 1.391 0 C-N-CA 122.992 0.517 . . . . 50.75 111.63 172.233 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -61.37 137.99 73.72 Favored 'Trans proline' 0 CA--C 1.535 0.575 0 C-N-CA 117.867 -0.956 . . . . 43.630000000000003 110.879 -176.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 54.6 p-80 -55.23 -34.69 64.2 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 114.104 1.15 . . . . 45.579999999999998 114.104 -178.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -73.97 -8.15 55.02 Favored 'General case' 0 N--CA 1.475 0.8 0 O-C-N 124.025 0.828 . . . . 59.990000000000002 112.893 -177.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 25.6 tp -87.03 -12.78 46.34 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 109.076 -0.713 . . . . 50.170000000000002 109.076 174.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 31.4 mt -84.01 143.88 29.49 Favored 'General case' 0 CA--C 1.511 -0.529 0 N-CA-C 115.458 1.651 . . . . 45.810000000000002 115.458 -171.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.637 ' OE1' HG23 ' A' ' 12' ' ' THR . 5.5 tm-20 -57.42 130.45 46.33 Favored 'General case' 0 CA--C 1.549 0.936 0 CA-C-N 112.43 -2.168 . . . . 53.600000000000001 106.923 171.787 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.73 -38.49 75.41 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.718 1.747 . . . . 48.710000000000001 115.718 -168.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -72.36 -39.65 67.94 Favored 'General case' 0 CA--C 1.506 -0.738 0 N-CA-C 113.761 1.022 . . . . 60.740000000000002 113.761 179.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' THR . . . . . 0.637 HG23 ' OE1' ' A' ' 9' ' ' GLU 0.278 0.7 OUTLIER -64.41 -39.75 94.44 Favored 'General case' 0 C--O 1.187 -2.232 0 C-N-CA 116.815 -1.954 . . . . 51.939999999999998 107.727 176.11 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 23.7 tp -58.68 -39.92 82.06 Favored 'General case' 0 N--CA 1.487 1.403 0 CA-C-N 119.545 1.066 . . . . 38.990000000000002 112.617 177.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -64.85 -43.04 94.32 Favored 'General case' 0 CA--C 1.476 -1.891 0 N-CA-C 111.946 0.35 . . . . 51.5 111.946 -178.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -62.44 -45.59 92.39 Favored 'General case' 0 CA--C 1.548 0.9 0 O-C-N 125.313 1.633 . . . . 48.789999999999999 110.796 175.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 52.0 mt -59.17 -41.86 89.43 Favored 'General case' 0 N--CA 1.503 2.209 0 O-C-N 122.13 -0.356 . . . . 34.759999999999998 111.368 174.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 31.4 mt -64.23 -46.34 84.24 Favored 'General case' 0 N--CA 1.476 0.857 0 CA-C-O 120.541 0.21 . . . . 33.890000000000001 111.36 179.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -60.83 -46.11 91.83 Favored 'General case' 0 C--O 1.25 1.085 0 C-N-CA 123.146 0.579 . . . . 52.369999999999997 111.984 176.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 94.0 m-20 -53.61 -47.65 70.0 Favored 'General case' 0 N--CA 1.482 1.172 0 CA-C-O 121.252 0.549 . . . . 45.359999999999999 110.804 174.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 78.6 t80 -63.11 -49.48 74.28 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-N 116.31 -0.405 . . . . 38.460000000000001 110.022 -172.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 12.9 m -75.81 -8.84 12.18 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 113.133 0.79 . . . . 40.939999999999998 113.133 -174.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 44.1 p -109.73 6.87 24.0 Favored 'General case' 0 N--CA 1.44 -0.973 0 C-N-CA 118.719 -1.192 . . . . 47.490000000000002 112.833 170.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.5 ptt180 . . . . . 0 N--CA 1.488 1.459 0 N-CA-C 115.178 1.547 . . . . 64.730000000000004 115.178 -176.77 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 . . . . . 0 CA--C 1.561 1.394 0 CA-C-O 121.502 0.667 . . . . 66.549999999999997 111.217 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 63.2 m -59.64 132.27 88.7 Favored Pre-proline 0 C--O 1.211 -0.924 0 O-C-N 121.244 -0.91 . . . . 49.869999999999997 110.647 177.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_exo -58.85 152.6 56.32 Favored 'Trans proline' 0 C--O 1.256 1.377 0 CA-C-N 118.805 0.609 . . . . 43.520000000000003 113.107 177.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 19.0 tp -48.74 -51.41 29.06 Favored 'General case' 0 C--O 1.24 0.56 0 N-CA-C 114.137 1.162 . . . . 45.810000000000002 114.137 178.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.42 -39.14 86.32 Favored 'General case' 0 N--CA 1.425 -1.686 0 O-C-N 124.446 1.091 . . . . 55.909999999999997 113.766 -176.546 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 27.7 t -61.76 -46.67 96.03 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.674 0 CA-C-O 122.251 1.024 . . . . 37.869999999999997 111.291 173.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 71.8 mtm180 -61.69 -39.53 91.78 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 115.314 -0.857 . . . . 59.420000000000002 111.021 178.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 44.9 t -63.89 -43.3 97.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.603 0 N-CA-C 109.237 -0.653 . . . . 31.260000000000002 109.237 177.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -65.22 -37.32 86.89 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 119.369 -0.932 . . . . 52.039999999999999 111.546 179.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 -61.72 -40.19 94.18 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 108.867 -0.79 . . . . 41.549999999999997 108.867 175.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.57 -35.82 77.91 Favored 'General case' 0 CA--C 1.566 1.571 0 CA-C-O 121.937 0.875 . . . . 29.82 112.945 178.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 84.5 mtt-85 -64.2 -40.06 95.28 Favored 'General case' 0 N--CA 1.44 -0.947 0 O-C-N 121.138 -0.976 . . . . 46.810000000000002 110.818 177.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.645 ' CD2' ' H2 ' ' A' ' 103' ' ' GOL . 72.5 t60 -62.59 -44.62 95.87 Favored 'General case' 0 N--CA 1.48 1.035 0 O-C-N 124.039 0.837 . . . . 38.75 109.756 175.573 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.93 -39.17 80.77 Favored 'General case' 0 C--O 1.248 0.992 0 N-CA-C 108.591 -0.892 . . . . 29.239999999999998 108.591 178.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 59.8 mt -66.44 -43.79 84.64 Favored 'General case' 0 C--O 1.296 3.507 0 CA-C-O 121.33 0.586 . . . . 31.120000000000001 111.507 176.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 81.4 mtm-85 -59.89 -36.22 76.49 Favored 'General case' 0 C--O 1.246 0.917 0 N-CA-C 113.971 1.1 . . . . 42.280000000000001 113.971 173.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 69.6 mtp85 -82.83 -1.35 51.63 Favored 'General case' 0 N--CA 1.502 2.129 0 CA-C-O 121.763 0.792 . . . . 35.969999999999999 112.655 178.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 65.29 18.94 65.83 Favored Glycine 0 N--CA 1.469 0.892 0 N-CA-C 116.124 1.209 . . . . 31.309999999999999 116.124 -173.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 91.6 mt-10 -89.09 -14.45 36.25 Favored 'General case' 0 C--O 1.203 -1.35 0 N-CA-C 113.613 0.968 . . . . 40.490000000000002 113.613 178.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -121.04 147.9 44.88 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 105.001 -2.222 . . . . 29.940000000000001 105.001 162.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.49 ' HB ' ' H12' ' A' ' 101' ' ' GOL . 32.6 m -135.5 170.62 18.8 Favored 'Isoleucine or valine' 0 C--O 1.269 2.117 0 N-CA-C 107.701 -1.222 . . . . 29.940000000000001 107.701 -179.912 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.907 ' H ' ' H2 ' ' A' ' 101' ' ' GOL . 44.2 mt -118.08 123.39 71.57 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.3 0 CA-C-N 115.09 -0.959 . . . . 35.740000000000002 109.745 176.993 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.927 HD23 HD23 ' A' ' 2' ' ' LEU . 23.3 mt -97.61 134.52 40.7 Favored 'General case' 0 N--CA 1.438 -1.026 0 O-C-N 124.809 1.318 . . . . 42.289999999999999 111.835 174.949 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.464 ' O ' ' HA ' ' A' ' 0' ' ' HIS . 67.0 t80 -122.92 132.29 54.1 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-N 115.141 -0.936 . . . . 47.299999999999997 112.022 179.554 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 60.7 t0 -103.7 108.95 61.16 Favored Pre-proline 0 C--O 1.206 -1.196 0 O-C-N 124.566 1.166 . . . . 56.450000000000003 109.61 179.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -35.84 -54.46 0.79 Allowed 'Trans proline' 0 N--CA 1.483 0.892 1 C-N-CA 128.184 5.923 . . . . 60.469999999999999 114.114 173.635 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.445 ' O ' ' CB ' ' A' ' 58' ' ' SER . 14.9 pt-20 -97.11 141.02 30.75 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 107.178 -1.416 . . . . 67.480000000000004 107.178 173.976 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' SER . . . . . 0.445 ' CB ' ' O ' ' A' ' 57' ' ' GLU . 9.6 p 86.18 -28.04 0.08 Allowed 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.642 -1.244 . . . . 61.939999999999998 107.642 -163.939 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 50.84 18.02 0.47 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.173 0.989 . . . . 60.759999999999998 113.567 -176.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 7.4 mt-30 -86.86 147.57 25.74 Favored 'General case' 0 CA--C 1.56 1.361 0 CA-C-O 121.625 0.726 . . . . 67.049999999999997 112.94 -174.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.415 ' SG ' HD11 ' A' ' 3' ' ' ILE . 9.2 m -112.42 152.58 28.5 Favored 'General case' 0 C--O 1.255 1.355 0 C-N-CA 124.987 1.315 . . . . 51.420000000000002 109.17 179.377 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -149.57 138.2 20.9 Favored 'General case' 0 CA--C 1.56 1.34 0 CA-C-N 114.896 -1.047 . . . . 47.189999999999998 113.058 166.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -81.15 133.54 35.48 Favored 'General case' 0 N--CA 1.439 -1.021 0 N-CA-C 107.59 -1.263 . . . . 42.380000000000003 107.59 173.568 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 49.1 mtp -140.18 149.2 42.66 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 124.408 1.067 . . . . 36.859999999999999 110.205 178.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 74.6 mt -66.37 130.86 44.63 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 108.122 -1.066 . . . . 39.090000000000003 108.122 167.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ARG . . . . . . . . . . . . . 57.5 ttm-85 -45.24 -39.9 6.9 Favored 'General case' 0 N--CA 1.5 2.028 0 C-N-CA 122.859 0.463 . . . . 34.670000000000002 110.743 174.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 57.9 p -63.5 -23.54 67.44 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.909 1.283 . . . . 36.140000000000001 114.051 -179.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 77.2 mt-10 -94.12 -3.26 51.4 Favored 'General case' 0 C--O 1.253 1.247 0 N-CA-C 115.952 1.834 . . . . 48.630000000000003 115.952 176.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 26.9 t -90.47 127.99 50.63 Favored Pre-proline 0 CA--C 1.556 1.18 0 CA-C-N 115.011 -0.995 . . . . 34.920000000000002 110.693 179.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PRO . . . . . . . . . . . . . 99.0 Cg_exo -54.94 145.04 64.86 Favored 'Trans proline' 0 C--N 1.373 1.834 0 C-N-CA 120.867 1.044 . . . . 36.390000000000001 113.388 171.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.43 -37.56 72.98 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 119.412 -0.915 . . . . 36.990000000000002 111.405 -175.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 21.0 tp10 -54.03 -33.99 58.79 Favored 'General case' 0 C--O 1.198 -1.625 0 O-C-N 123.779 0.675 . . . . 64.230000000000004 112.553 179.374 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 31.1 mt -90.27 -2.98 58.06 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 115.202 1.556 . . . . 49.009999999999998 115.202 179.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 46.3 mt -103.56 -12.31 17.17 Favored 'General case' 0 C--O 1.246 0.885 0 N-CA-C 112.448 0.536 . . . . 51.789999999999999 112.448 174.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.504 ' O ' ' HB2' ' A' ' 76' ' ' ASP . 1.3 mmp_? -80.48 105.16 11.52 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 126.54 1.936 . . . . 75.530000000000001 110.378 165.761 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.504 ' HB2' ' O ' ' A' ' 75' ' ' ARG . 8.9 t70 . . . . . 0 C--O 1.252 1.191 0 O-C-N 123.818 0.698 . . . . 68.280000000000001 110.073 -153.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GOL . . . . . 1.027 ' O2 ' ' O ' ' A' ' 3' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GOL . . . . . 0.782 ' HO1' ' HO3' ' A' ' 102' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GOL . . . . . 0.782 ' HO3' ' HO1' ' A' ' 104' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GOL . . . . . 0.696 ' O2 ' ' O ' ' A' ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . 0.598 ' O ' ' HB3' ' A' ' 1' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . 0.696 ' O ' ' O2 ' ' A' ' 103' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_